Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 3/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL10992363 | 0.86 | SLC6A4 (0.45) | SLC6A4SLC6A2NPSR1HRH3 | |
| SCHEMBL10985198 | 0.85 | TAAR1 (0.41) | SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL10994762 | 0.85 | CHRNB2 (0.51) | KDM4E | |
| SCHEMBL10991955 | 0.85 | KDM4E (0.48) | SLC6A4SLC6A2SLC6A3KDM4ECYP2D6 | |
| SCHEMBL10994963 | 0.85 | SLC6A4 (0.35) | SLC6A4SLC6A2SMN1; SMN2ACHEKDM4E | |
| SCHEMBL10994633 | 0.84 | ATM (0.40) | KMT2AMAPTKDM4ECYP2D6CYP2C19 | |
| SCHEMBL10984555 | 0.84 | SLC6A4 (0.45) | SLC6A4SLC6A2SLC6A3KDM4ELMNA | |
| SCHEMBL10989079 | 0.83 | GHSR (0.37) | SLC6A4SLC6A2KMT2ANPC1TP53 | |
| SCHEMBL10993415 | 0.82 | SLC6A4 (0.42) | SLC6A4SLC6A2SLC6A3KMT2AMAPT | |
| SCHEMBL10996291 | 0.82 | SLC6A9 (0.44) | SLC6A4SLC6A2SLC6A3KDM4EHRH3 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4500541-A | Pharmacologically active cyclopropane derivatives | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1985-02-19 | — | — | US | disclosed |
| EP-0039771-B1 | CYCLOPROPANE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESSES FOR THEIR PRODUCTION | MERCK PATENT GmbH (DE) | 1983-10-19 | — | — | EP | disclosed |
| EP-0039771-A1 | Cyclopropane derivatives, pharmaceutical compositions containing them and processes for their production | MERCK PATENT GmbH (DE) | 1981-11-18 | — | — | EP | disclosed |